TAK-441
HIT212674147
sdf文件结构编辑类似物检索
HIT ID: HIT212674147
Cas No: 1186231-83-3
分子式: C28H31F3N4O6
分子量: 576.573
常用名: TAK-441
氢键受体数 (HBA): 6
氢键供体数 (HBD): 2
LogP: 0.95647943
IUPAC: 6-ethyl-N-[1-(2-hydroxyacetyl)piperidin-4-yl]-1-methyl-4-oxo-5-(2-oxo-2-phenylethyl)-3-(2,2,2-trifluoroethoxy)-1H,4H,5H-pyrrolo[3,2-c]pyridine-2-carboxamide
IUPAC: 6-ethyl-N-[1-(2-hydroxyacetyl)piperidin-4-yl]-1-methyl-4-oxo-5-(2-oxo-2-phenylethyl)-3-(2,2,2-trifluoroethoxy)-1H,4H,5H-pyrrolo[3,2-c]pyridine-2-carboxamide
SMILES: CCc1cc2n(C)c(C(=O)NC3CCN(CC3)C(=O)CO)c(OCC(F)(F)F)c2c(=O)n1CC(=O)c1ccccc1
SMILES: CCc1cc2n(C)c(C(=O)NC3CCN(CC3)C(=O)CO)c(OCC(F)(F)F)c2c(=O)n1CC(=O)c1ccccc1
InChI key: ZADWXQMNNVICKB-UHFFFAOYSA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
7871-3天 购物车
Mcule
SC
12084-5周 购物车
TargetMol | Target Loading
正在加载 ~